BIOPEP-UWM: Report

ID 704
Name ACE inhibitor
sequence
CS

Function:
Predicted inhibitor of Angiotensin-Converting Enzyme (ACE) (EC 3.4.15.1) (MEROPS ID: M02-001) (PDB ID: 1O86)
 
Number of residues
2
Activity code
ah
Activity :
ACE inhibitor
Chemical mass 208.2361 Monoisotopic mass 208.0515
EC50 :
0.00 µM



Bibliographic data:
Authors
Chen J., Xie R., Mei Y., Chen W., Hu J., Liu H., Du H., Hao G., Ji X., Li S., Zhang J.
Title
Prospecting of novel angiotensin I-converting enzyme inhibitory peptides from bone collagen of Pelodiscus sinensis by computer-aided screening, molecular docking, and network pharmacology. Foods, 15, 663, 2026
Year Source
2026 Journal



Additional information:
BIOPEP-UWM Virtual database


SMILES: N[C@@]([H])(CS)C(=O)N[C@@]([H])(CO)C(=O)O

InChI=1S/C6H12N2O4S/c7-3(2-13)5(10)8-4(1-9)6(11)12/h3-4,9,13H,1-2,7H2,(H,8,10)(H,11,12)/t3-,4-/m0/s1

InChIKey=YXQDRIRSAHTJKM-IMJSIDKUSA-N


Bioactivity predicted by molecular docking



Database reference:
BRENDA: Ligand L-cysteinyl-L-serine

CAS: ID 629653-14-1

ChEBI: ID 73462

ChemSpider: ID 28639328

EPA CompTox: ID DTXSID801369499

FooDB: ID FDB098196

HMDB: ID HMDB0028784

Metabolomics Workbench: ID 78751

PubChem: CID 54532705

SureChEMBL: ID SCHEMBL27820989

UniChem: ID 25676415

Wikidata: ID Q27140547